[(2S)-1-(3-methylphenyl)sulfonylpyrrolidin-2-yl]methylazanium

Systemtic Name: [(2S)-1-(3-methylphenyl)sulfonylpyrrolidin-2-yl]methylazanium Openeye Name: [(2S)-1-(m-tolylsulfonyl)pyrrolidin-2-yl]methylammonium CAS Name: [(2S)-1-(3-methylphenyl)sulfonyl-2-pyrrolidinyl]methylammonium IUPAC Name: [(2S)-1-(3-methylphenyl)sulfonylpyrrolidin-2-yl]methylazanium Traditional Name: [(2S)-1-(m-tolylsulfonyl)pyrrolidin-2-yl]methylammonium Formula: C12H19N2O2S+ MolecularWeight: 255.35646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)N2CCCC2C[NH3+]

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)N2CCC[C@H]2C[NH3+]

InChI

InChI=1S/C12H18N2O2S/c1-10-4-2-6-12(8-10)17(15,16)14-7-3-5-11(14)9-13/h2,4,6,8,11H,3,5,7,9,13H2,1H3/p+1/t11-/m0/s1